4-[(Z)-1,2-dicyanoethenyl]-2-iodanyl-6-methoxy-phenolate; 3-methoxypropylazanium

Systemtic Name: 4-[(Z)-1,2-dicyanoethenyl]-2-iodanyl-6-methoxy-phenolate; 3-methoxypropylazanium Openeye Name: 4-[(Z)-1,2-dicyanovinyl]-2-iodo-6-methoxy-phenolate; 3-methoxypropylammonium CAS Name: 4-[(Z)-1,2-dicyanoethenyl]-2-iodo-6-methoxyphenolate; 3-methoxypropylammonium IUPAC Name: 4-[(Z)-1,2-dicyanoethenyl]-2-iodo-6-methoxyphenolate; 3-methoxypropylazanium Traditional Name: 4-[(Z)-1,2-dicyanovinyl]-2-iodo-6-methoxy-phenolate; 3-methoxypropylammonium Formula: C15H18IN3O3 MolecularWeight: 415.22619

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH3+].COC1=C(C(=CC(=C1)C(=CC#N)C#N)I)[O-]

Isomeric SMILES

COCCC[NH3+].COC1=C(C(=CC(=C1)/C(=C/C#N)/C#N)I)[O-]

InChI

InChI=1S/C11H7IN2O2.C4H11NO/c1-16-10-5-8(4-9(12)11(10)15)7(6-14)2-3-13;1-6-4-2-3-5/h2,4-5,15H,1H3;2-5H2,1H3/b7-2+;